Geometry & MOs

Info

ID:	254529
PubChem CID:	103125899
Reduced:	N3O3H9C10 (1)
Stoich.:	A3B3C9D10 (1)
Weight, g/mol:	222.173213
ΔH_f, kcal/mol:	-4.51
Dipole, Da:	7.29
IP(EA), eV:	-9.02(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,3,5,5-tetramethylcyclohexyl)-1H-imidazol-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)[N+](=O)[O-])N2C=CNC2=O

DOS

IR

Vibrations